Hydrogen Sulfide

Hydrogen Sulfide

SCHEMBL23406476

C=CC(=O)CCCCC.C=CC(=O)CCCCC.S.S.S.S

nearest known ligand 0.52

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.52
FAAH O00519 2/20 0.52
TSHR P16473 6/20 0.50
CES2 O00748 4/20 0.50
CES1 P23141 4/20 0.50
ALDH1A1 P00352 3/20 0.50
AKR1B1 P15121 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPK1 P28482 1/20 0.47
HSP90AA1 P07900 1/20 0.46
PPARG P37231 6/20 0.46
PPARD Q03181 6/20 0.46
PPARA Q07869 6/20 0.46
GPR84 Q9NQS5 5/20 0.46
HDAC11 Q96DB2 5/20 0.46
TLR2 O60603 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
FABP4 P15090 2/20 0.46
PTPN1 P18031 2/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrogen Sulfide SCHEMBL23406532 1.00 TRPA1 (0.52) TRPA1FAAHTSHRCES2CES1
SCHEMBL84084 0.98
SCHEMBL7110229 0.98
SCHEMBL872361 0.95 FAAH (0.57) TRPA1FAAHTSHRCES2CES1
SCHEMBL2301761 0.95 FAAH (0.57) TRPA1FAAHTSHRCES2CES1
SCHEMBL12198766 0.95 FAAH (0.57) TRPA1FAAHTSHRCES2CES1
SCHEMBL812162 0.95 FAAH (0.57) TRPA1FAAHTSHRCES2CES1
SCHEMBL8758532 0.95 FAAH (0.57) TRPA1FAAHTSHRCES2CES1
SCHEMBL21423341 0.95 FAAH (0.57) TRPA1FAAHTSHRCES2CES1
SCHEMBL3391061 0.95 FAAH (0.57) TRPA1FAAHTSHRCES2CES1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11530319-B2 Rubber composition and pneumatic tire using the same TOYO TIRE CORPORATION (JP) 2022-12-20 US disclosed
US-20210163718-A1 RUBBER COMPOSITION AND PNEUMATIC TIRE USING THE SAME TOYO TIRE CORPORATION (JP) 2021-06-03 US disclosed